Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TP53 | P04637 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9735404 | 1.00 | GLA (0.44) | GLAALDH1A3CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL9736051 | 0.81 | NPC1 (0.50) | CA1CA2CA9ALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL9736049 | 0.81 | NPC1 (0.50) | CA1CA2CA9ALDH1A1TP53 | |
| SCHEMBL9735736 | 0.76 | MAPT (0.51) | CA1CA2CA9ALDH1A1KMT2A | |
| SCHEMBL9735732 | 0.76 | MAPT (0.51) | CA1CA2CA9ALDH1A1KMT2A | |
| SCHEMBL9734847 | 0.74 | SMN1; SMN2 (0.49) | GLACA1CA2CA9ALDH1A1 | |
| SCHEMBL2094236 | 0.74 | ALDH1A3 (0.57) | GLAALDH1A3CA1CA2CA9 | |
| SCHEMBL9734844 | 0.74 | SMN1; SMN2 (0.49) | GLACA1CA2CA9ALDH1A1 | |
| SCHEMBL9736679 | 0.74 | NPC1 (0.57) | CA1CA2CA9CA12ALDH1A1 | |
| SCHEMBL9735698 | 0.73 | RAB9A (0.49) | CA1CA2CA9CA12ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5112866-A | Sulfonylfluorides as intermediates, also useful in treatment of bone disorders, antisecretory, antiulcer | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-05-12 | — | — | US | disclosed |